N-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-[(2-nitro-4-sulfamoyl-phenyl)amino]propanamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-3-(2-nitro-4-sulfamoyl-anilino)propanamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-3-(2-nitro-4-sulfamoylanilino)propanamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-3-(2-nitro-4-sulfamoylanilino)propanamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-3-(2-nitro-4-sulfamoyl-anilino)propionamide Formula: C16H14ClF3N4O5S MolecularWeight: 466.81937

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])C(F)(F)F)Cl

InChI

InChI=1S/C16H14ClF3N4O5S/c17-12-3-1-9(7-11(12)16(18,19)20)23-15(25)5-6-22-13-4-2-10(30(21,28)29)8-14(13)24(26)27/h1-4,7-8,22H,5-6H2,(H,23,25)(H2,21,28,29)